(1S)-1-[4-ethyl-5-[(3-methoxyphenyl)methylsulfonyl]-1,2,4-triazol-3-yl]-2-phenyl-ethanamine

Systemtic Name: (1S)-1-[4-ethyl-5-[(3-methoxyphenyl)methylsulfonyl]-1,2,4-triazol-3-yl]-2-phenyl-ethanamine Openeye Name: (1S)-1-[4-ethyl-5-[(3-methoxyphenyl)methylsulfonyl]-1,2,4-triazol-3-yl]-2-phenyl-ethanamine CAS Name: (1S)-1-[4-ethyl-5-[(3-methoxyphenyl)methylsulfonyl]-1,2,4-triazol-3-yl]-2-phenylethanamine IUPAC Name: (1S)-1-[4-ethyl-5-[(3-methoxyphenyl)methylsulfonyl]-1,2,4-triazol-3-yl]-2-phenylethanamine Traditional Name: [(1S)-1-(4-ethyl-5-m-anisylsulfonyl-1,2,4-triazol-3-yl)-2-phenyl-ethyl]amine Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1S(=O)(=O)CC2=CC(=CC=C2)OC)C(CC3=CC=CC=C3)N

Isomeric SMILES

CCN1C(=NN=C1S(=O)(=O)CC2=CC(=CC=C2)OC)[C@H](CC3=CC=CC=C3)N

InChI

InChI=1S/C20H24N4O3S/c1-3-24-19(18(21)13-15-8-5-4-6-9-15)22-23-20(24)28(25,26)14-16-10-7-11-17(12-16)27-2/h4-12,18H,3,13-14,21H2,1-2H3/t18-/m0/s1